Data Item _refine_ls_shell.R_factor_R_work
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General 
- Item name
- _refine_ls_shell.R_factor_R_work
- Category name
- refine_ls_shell
- Attribute name
- R_factor_R_work
- Required in PDB entries
- no
- Used in current PDB entries
- Yes, in about 74.9 % of entries
Item Description
Residual factor R for reflections that satisfy the resolution
limits established by _refine_ls_shell.d_res_high and
_refine_ls_shell.d_res_low and the observation limit
established by _reflns.observed_criterion, and that were used
as the working reflections (i.e. were included in the
refinement) when the refinement included the calculation of
a 'free' R factor. Details of how reflections were assigned
to the working and test sets are given in _reflns.R_free_details.
sum|Fobs - Fcalc|
R = ---------------------
sum|Fobs|
Fobs = the observed structure-factor amplitudes
Fcalc = the calculated structure-factor amplitudes
sum is taken over the specified reflections
Additional Descriptive Information for Depositors
Within the indicated shell, Sum(abs((abs(F-obs)-abs(F-calc)))/Sum(abs(F-obs)) on working data, i.e. the data used in calculating the structural model throughout the structure solution and refinement process
Data Type 
- Data type code
- float
- Data type detail
- float item types are the subset of numbers that are the floating numbers.
- Primitive data type code
- numb
- Regular expression
- -?(([0-9]+)[.]?|([0-9]*[.][0-9]+))([(][0-9]+[)])?([eE][+-]?[0-9]+)?
Allowed Boundary Conditions
| Minimum Value | Maximum Value |
|---|---|
| 0.0 | +∞ |
Advisory Boundary Conditions
| Minimum Value | Maximum Value |
|---|---|
| 0.1 | 0.35 |
| 0 | 1 |
Related Items 
| Related Item Name | Relation Type |
|---|---|
| _refine_ls_shell.wR_factor_R_work | alternate |